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1-METHYL-7-FLUORO-1,4-DIHYDRO-4-OXO-8-[1'-(4'-N-SUCCINYLPIPERAZINYL)]-3-BENZO-[B]-[1,8]-NAPHTHYRIDINE-CARBOXYLIC-ACID
SpectraBase Compound ID FnrD0sewcNt
InChI InChI=1S/C22H21FN4O6/c1-25-11-14(22(32)33)20(31)13-8-12-9-15(23)17(10-16(12)24-21(13)25)26-4-6-27(7-5-26)18(28)2-3-19(29)30/h8-11H,2-7H2,1H3,(H,29,30)(H,32,33)
InChIKey PZEDYGDBBXFOPA-UHFFFAOYSA-N
Mol Weight 456.43 g/mol
Molecular Formula C22H21FN4O6
Exact Mass 456.144513 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Fg2preeONyT
Name 1-METHYL-7-FLUORO-1,4-DIHYDRO-4-OXO-8-[1'-(4'-N-SUCCINYLPIPERAZINYL)]-3-BENZO-[B]-[1,8]-NAPHTHYRIDINE-CARBOXYLIC-ACID
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21FN4O6
InChI InChI=1S/C22H21FN4O6/c1-25-11-14(22(32)33)20(31)13-8-12-9-15(23)17(10-16(12)24-21(13)25)26-4-6-27(7-5-26)18(28)2-3-19(29)30/h8-11H,2-7H2,1H3,(H,29,30)(H,32,33)
InChIKey PZEDYGDBBXFOPA-UHFFFAOYSA-N
Literature Reference Author C.HENNARD,Q.C.TRUONG,J.F.DESNOTTES,J.M.PARIS,N.J.MOREAU,M.A. ABDALLAH
Literature Reference Citation J.MED.CHEM.,44,2139(2001)
Literature Reference DOI 10.1021/jm990508g
Molecular Weight 456.430 g/mol
Sample ID 44555
Solvent DMSO-D6